N-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]-N-methyl-naphthalene-2-sulfonamide

Systemtic Name: N-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]-N-methyl-naphthalene-2-sulfonamide Openeye Name: N-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]-N-methyl-naphthalene-2-sulfonamide CAS Name: N-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-N-methyl-2-naphthalenesulfonamide IUPAC Name: N-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-N-methylnaphthalene-2-sulfonamide Traditional Name: N-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]-N-methyl-naphthalene-2-sulfonamide Formula: C20H20BrNO4S MolecularWeight: 450.3461

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC(=CC=C1)Br)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CN(C[C@@H](COC1=CC(=CC=C1)Br)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H20BrNO4S/c1-22(13-18(23)14-26-19-8-4-7-17(21)12-19)27(24,25)20-10-9-15-5-2-3-6-16(15)11-20/h2-12,18,23H,13-14H2,1H3/t18-/m0/s1